Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 1/20 | 0.50 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.49 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.48 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.46 |
| ▸ | CASR | P41180 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1041491 | 0.91 | CYP4F2 (0.52) | MMP8CYP4F2CYP4A11NPSR1TSHR | |
| SCHEMBL8330814 | 0.82 | PTGS1 (0.58) | MMP8NPSR1PTGS1PTGS2KDM4E | |
| SCHEMBL5166543 | 0.80 | CYP4F2 (0.58) | LOXL2CYP4F2CYP4A11NPSR1TSHR | |
| SCHEMBL20032090 | 0.80 | LOXL2 (0.53) | LOXL2CYP4F2CYP4A11SLC7A5CASR | |
| SCHEMBL1491141 | 0.79 | MMP8 (0.53) | MMP8KDM4EALDH1A1 | |
| SCHEMBL14254979 | 0.79 | MMP8 (0.54) | MMP8KDM4EALDH1A1KMT2A | |
| SCHEMBL29841550 | 0.79 | MMP8 (0.54) | MMP8KDM4EALDH1A1KMT2A | |
| SCHEMBL10606809 | 0.78 | LOXL2 (0.51) | LOXL2CYP4F2CYP4A11SLC7A5CASR | |
| SCHEMBL5662355 | 0.78 | LOXL2 (0.51) | LOXL2CYP4F2CYP4A11SLC7A5CASR | |
| SCHEMBL1787505 | 0.78 | HDAC4 (0.51) | LOXL2CYP4F2CYP4A11SLC7A5CASR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107266275-B | Compound containing monofluoromethyl, preparation method and application thereof | 中国科学院上海有机化学研究所 | 2020-07-07 | — | — | CN | disclosed |
| CN-107266275-A | A kind of compound for containing a methyl fluoride, its preparation method and application | 中国科学院上海有机化学研究所 | 2017-10-20 | — | — | CN | disclosed |